CAS 1776948-12-9 is the registry number for hBChE-IN-1. Offered by: MedChemExpress. Available pack sizes: Get quote.
1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one (CAS 1776948-12-9) is a chemical compound with the molecular formula C27H34N2OS2 and a molecular weight of 466.7 g/mol. IUPAC name: 1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one. InChIKey: RTSVPQGEMHVGDV-NZQKXSOJSA-N.
| Molecular formula | C27H34N2OS2 |
|---|---|
| Molecular weight | 466.7 g/mol |
| IUPAC name | 1-[3-[[(1R,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-yl]methylsulfanyl]propylamino]-4-methylthioxanthen-9-one |
| InChIKey | RTSVPQGEMHVGDV-NZQKXSOJSA-N |
| SMILES | CC1=C2C(=C(C=C1)NCCCSC[C@@H]3CCCN4[C@@H]3CCCC4)C(=O)C5=CC=CC=C5S2 |
Computed by PubChem (NCBI)